6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane

C10H18FN — CID 156813146

IUPAC6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
SMILESCC(C)N1CC2(C1)CC(C)(F)C2
InChIInChI=1S/C10H18FN/c1-8(2)12-6-10(7-12)4-9(3,11)5-10/h8H,4-7H2,1-3H3
InChIKeyNOBUXNGGHLWHDU-UHFFFAOYSA-N
MW171.26 g/mol
LogP2.22
Rot. Bonds1

About 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane

6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane (PubChem CID 156813146) has the molecular formula C10H18FN and a molecular weight of 171.26 g/mol. Its IUPAC name is 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
PubChem CID156813146
Molecular FormulaC10H18FN
Molecular Weight171.26 g/mol
Exact Mass171.14
IUPAC Name6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane
SMILESCC(C)N1CC2(C1)CC(C)(F)C2
InChIInChI=1S/C10H18FN/c1-8(2)12-6-10(7-12)4-9(3,11)5-10/h8H,4-7H2,1-3H3
InChIKeyNOBUXNGGHLWHDU-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.26
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,6-di(propan-2-yl)-2,6-diazaspiro[3.3]heptane
CID 20781150
2-propan-2-yl-8-oxa-2-azadispiro[3.1.36.14]decane
CID 146419325
1-(6-fluoro-6-methyl-2-azaspiro[3.3]heptan-2-yl)-2-methylpropan-1-one
CID 162092392
ethane;2-propan-2-yl-2,6-diazaspiro[3.3]heptane
CID 160577480
3,3,4-trifluoro-4-methyl-1-propan-2-ylpyrrolidine
CID 159310583
5,5-difluoro-3-methyl-1-propan-2-ylpiperidin-3-ol
CID 178173049
2,2-difluoro-6-propan-2-yl-6-azaspiro[3.4]octane;ethane
CID 170740276
2-hydroxy-6-propan-2-yl-2,6-diazaspiro[3.3]heptane
CID 157227822
2-propan-2-yl-2-azaspiro[3.4]octane
CID 118357245
3-fluoro-3-methyl-1-propan-2-ylazetidine;methane;1-propan-2-ylazetidine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 159989792
6-(difluoromethyl)-2-propan-2-yl-2-azaspiro[3.3]heptane;ethane
CID 172624374
ethane;2,2,6,6-tetramethyl-4-propan-2-ylmorpholine
CID 178173229

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane?
The IUPAC name of 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane (CID 156813146) is 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane.
What is the SMILES notation for 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane?
The canonical SMILES for 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane is CC(C)N1CC2(C1)CC(C)(F)C2.
What is the InChIKey of 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane?
The InChIKey is NOBUXNGGHLWHDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN/c1-8(2)12-6-10(7-12)4-9(3,11)5-10/h8H,4-7H2,1-3H3.
What are the key properties of 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane?
6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane has a molecular weight of 171.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-6-methyl-2-propan-2-yl-2-azaspiro[3.3]heptane is sourced from PubChem (CID 156813146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).